SCHEMBL5132571

SCHEMBL5132571

CC(C)(C)OC(=O)NC1Cc2ccccc2N(Cc2ccccc2)C1=O

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 4/20 0.59
XIAP P98170 3/20 0.53
SCN9A Q15858 5/20 0.52
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
CCKBR P32239 1/20 0.46
PYGL P06737 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7416762 1.00 NPY1R (0.59) NPY1RXIAPSCN9AKMT2AL3MBTL1
SCHEMBL7417336 0.91 NPY1R (0.51) NPY1RXIAPSCN9AL3MBTL1CCKBR
SCHEMBL7418022 0.90 HDAC1 (0.50) NPY1RXIAPSCN9APYGL
SCHEMBL7421340 0.89 NPY1R (0.49) NPY1RXIAPSCN9ACCKBRPYGL
SCHEMBL7421160 0.89 SCN9A (0.48) NPY1RSCN9ACCKBR
SCHEMBL649566 0.88 NPY1R (0.52) NPY1RXIAPSCN9AKMT2AL3MBTL1
SCHEMBL5132457 0.88 NPY1R (0.52) NPY1RXIAPSCN9AKMT2AL3MBTL1
SCHEMBL649567 0.88 NPY1R (0.52) NPY1RXIAPSCN9AKMT2AL3MBTL1
SCHEMBL5651533 0.88 NPY1R (0.52) NPY1RXIAPSCN9AKMT2AL3MBTL1
SCHEMBL7421660 0.88 ACE (0.57) NPY1RSCN9ACCKBRPYGL

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644370-A4 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL MYERS SQUIBB CO (US) 2008-06-04 EP disclosed
US-7276608-B2 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2007-10-02 US disclosed
US-7276608-B2 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2007-10-02 US disclosed
US-7276608-B2 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2007-10-02 US disclosed
EP-1644370-A2 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS Bristol-Myers Squibb Company (US) 2006-04-12 EP disclosed
WO-2005007111-A2 TETRAHYDROQUINOLINE DERIVATIVES AS CANNABINOID RECEPTOR MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2005-01-27 WO disclosed
US-20050009870-A1 Tetrahydroquinoline derivatives as cannabinoid receptor modulators BRISTOL-MYERS SQUIBB COMPANY 2005-01-13 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050009870-A1 Tetrahydroquinoline derivatives as cannabinoid receptor modulators CNR2, CNR1, OPRL1 NPY1R 326/4885XIAP 4524/4885SCN9A 1971/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.